5-hexadecoxy-3-(4-nitrophenyl)-1,3,4-oxadiazol-2-one

Systemtic Name: 5-hexadecoxy-3-(4-nitrophenyl)-1,3,4-oxadiazol-2-one Openeye Name: 5-hexadecoxy-3-(4-nitrophenyl)-1,3,4-oxadiazol-2-one CAS Name: 5-hexadecoxy-3-(4-nitrophenyl)-1,3,4-oxadiazol-2-one IUPAC Name: 5-hexadecoxy-3-(4-nitrophenyl)-1,3,4-oxadiazol-2-one Traditional Name: 5-cetyloxy-3-(4-nitrophenyl)-1,3,4-oxadiazol-2-one Formula: C24H37N3O5 MolecularWeight: 447.56768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=NN(C(=O)O1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=NN(C(=O)O1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C24H37N3O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-31-23-25-26(24(28)32-23)21-16-18-22(19-17-21)27(29)30/h16-19H,2-15,20H2,1H3